5-(3,5-dimethylpiperazin-1-yl)quinoline

C15H19N3 — CID 81217174

IUPAC5-(3,5-dimethylpiperazin-1-yl)quinoline
SMILESCC1CN(c2cccc3ncccc23)CC(C)N1
InChIInChI=1S/C15H19N3/c1-11-9-18(10-12(2)17-11)15-7-3-6-14-13(15)5-4-8-16-14/h3-8,11-12,17H,9-10H2,1-2H3
InChIKeyJYHGZIKJAANHOR-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.42
Rot. Bonds1

About 5-(3,5-dimethylpiperazin-1-yl)quinoline

5-(3,5-dimethylpiperazin-1-yl)quinoline (PubChem CID 81217174) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 5-(3,5-dimethylpiperazin-1-yl)quinoline.

Molecular Properties

Compound Name5-(3,5-dimethylpiperazin-1-yl)quinoline
PubChem CID81217174
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name5-(3,5-dimethylpiperazin-1-yl)quinoline
SMILESCC1CN(c2cccc3ncccc23)CC(C)N1
InChIInChI=1S/C15H19N3/c1-11-9-18(10-12(2)17-11)15-7-3-6-14-13(15)5-4-8-16-14/h3-8,11-12,17H,9-10H2,1-2H3
InChIKeyJYHGZIKJAANHOR-UHFFFAOYSA-N
XLogP2.42
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(3,5-dimethylpiperazin-1-yl)-2-methylquinoline
CID 72527043
5-(4-benzyl-3,5-dimethylpiperazin-1-yl)quinoline
CID 20644634
5-pyrrolidin-1-ylquinoline
CID 118731129
5-piperazin-1-ylquinoline
CID 10656226
5-piperidin-1-ylquinoline
CID 12887802
methoxy-(5-methyl-1-quinolin-5-ylpiperidin-3-yl)methanol
CID 156648951
2-quinolin-5-yl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 79915081
1-tert-butyl-4-quinolin-5-ylpiperazine-2-carboxylic acid
CID 18414109
N-propyl-1-quinolin-5-ylpiperidin-4-amine
CID 43315003
(3R,5S)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-methyl-1-quinolin-5-ylpiperidin-3-amine
CID 141443264
6-(3,5-dimethylpiperidin-1-yl)quinolin-5-amine
CID 43809501
2-quinolin-5-yl-1,3-dihydroisoindol-5-amine
CID 43370073

Frequently Asked Questions

What is the IUPAC name of 5-(3,5-dimethylpiperazin-1-yl)quinoline?
The IUPAC name of 5-(3,5-dimethylpiperazin-1-yl)quinoline (CID 81217174) is 5-(3,5-dimethylpiperazin-1-yl)quinoline.
What is the SMILES notation for 5-(3,5-dimethylpiperazin-1-yl)quinoline?
The canonical SMILES for 5-(3,5-dimethylpiperazin-1-yl)quinoline is CC1CN(c2cccc3ncccc23)CC(C)N1.
What is the InChIKey of 5-(3,5-dimethylpiperazin-1-yl)quinoline?
The InChIKey is JYHGZIKJAANHOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-11-9-18(10-12(2)17-11)15-7-3-6-14-13(15)5-4-8-16-14/h3-8,11-12,17H,9-10H2,1-2H3.
What are the key properties of 5-(3,5-dimethylpiperazin-1-yl)quinoline?
5-(3,5-dimethylpiperazin-1-yl)quinoline has a molecular weight of 241.34 g/mol, XLogP of 2.42, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-dimethylpiperazin-1-yl)quinoline is sourced from PubChem (CID 81217174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).